PUBCHEM-ZINC05522749 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5240 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5130 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -0.2970 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -0.7740 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -1.4820 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -1.7150 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -1.2320 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -1.4610 -2.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -2.0650 -3.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -0.5280 2.2890 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9620 0.0950 3.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 -0.9480 2.2990 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.9010 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8860 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8760 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -0.3570 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1610 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.6030 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1360 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 0.2550 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -1.8540 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -2.2690 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -1.1900 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -1.5620 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -2.1620 -4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END